1-(benzenesulfonyl)-4-phenyl-3-propylimidazolidin-2-one

C18H20N2O3S — CID 15418827

IUPAC1-(benzenesulfonyl)-4-phenyl-3-propylimidazolidin-2-one
SMILESCCCN1C(=O)N(S(=O)(=O)c2ccccc2)CC1c1ccccc1
InChIInChI=1S/C18H20N2O3S/c1-2-13-19-17(15-9-5-3-6-10-15)14-20(18(19)21)24(22,23)16-11-7-4-8-12-16/h3-12,17H,2,13-14H2,1H3
InChIKeyGHBOODAQIZEYAR-UHFFFAOYSA-N
MW344.44 g/mol
LogP3.26
Rot. Bonds5

About 1-(benzenesulfonyl)-4-phenyl-3-propylimidazolidin-2-one

1-(benzenesulfonyl)-4-phenyl-3-propylimidazolidin-2-one (PubChem CID 15418827) has the molecular formula C18H20N2O3S and a molecular weight of 344.44 g/mol. Its IUPAC name is 1-(benzenesulfonyl)-4-phenyl-3-propylimidazolidin-2-one.

Molecular Properties

Compound Name1-(benzenesulfonyl)-4-phenyl-3-propylimidazolidin-2-one
PubChem CID15418827
Molecular FormulaC18H20N2O3S
Molecular Weight344.44 g/mol
Exact Mass344.12
IUPAC Name1-(benzenesulfonyl)-4-phenyl-3-propylimidazolidin-2-one
SMILESCCCN1C(=O)N(S(=O)(=O)c2ccccc2)CC1c1ccccc1
InChIInChI=1S/C18H20N2O3S/c1-2-13-19-17(15-9-5-3-6-10-15)14-20(18(19)21)24(22,23)16-11-7-4-8-12-16/h3-12,17H,2,13-14H2,1H3
InChIKeyGHBOODAQIZEYAR-UHFFFAOYSA-N
XLogP3.26
TPSA57.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.44
LogP ≤ 53.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-tert-butyl-1-(4-methylphenyl)sulfonyl-4-phenylimidazolidin-2-one
CID 15418830
3-(benzenesulfonyl)-4-methyl-1-propylimidazolidin-2-one
CID 15418833
1-(benzenesulfonyl)-2-phenylaziridine
CID 576325
(4R,5S)-1-(4-bromophenyl)sulfonyl-5-ethyl-4-phenylpiperidin-2-one
CID 139122161
(2R)-1-(benzenesulfonyl)-2-ethylaziridine
CID 22957230
(2R,5R)-1-(benzenesulfonyl)-2-methyl-5-phenylpyrrolidine
CID 59100228
5-phenyl-6-propyl-4,6-diazaspiro[2.4]heptan-7-one
CID 83242074
1-(4-methylphenyl)sulfonyl-2-phenylaziridine
CID 576319
1-(4-methylphenyl)sulfonyl-4-phenyl-2-propyl-4,5-dihydroimidazole
CID 101391819
1-(benzenesulfonyl)-4-[3-(2,5-dimethylphenyl)phenyl]-3-propan-2-ylimidazolidin-2-one
CID 44548557
(2R,3R)-1-(benzenesulfonyl)-2,3-diethylaziridine
CID 165347301
3-(benzenesulfonyl)-3-azabicyclo[3.1.0]hexane
CID 77427931

Frequently Asked Questions

What is the IUPAC name of 1-(benzenesulfonyl)-4-phenyl-3-propylimidazolidin-2-one?
The IUPAC name of 1-(benzenesulfonyl)-4-phenyl-3-propylimidazolidin-2-one (CID 15418827) is 1-(benzenesulfonyl)-4-phenyl-3-propylimidazolidin-2-one.
What is the SMILES notation for 1-(benzenesulfonyl)-4-phenyl-3-propylimidazolidin-2-one?
The canonical SMILES for 1-(benzenesulfonyl)-4-phenyl-3-propylimidazolidin-2-one is CCCN1C(=O)N(S(=O)(=O)c2ccccc2)CC1c1ccccc1.
What is the InChIKey of 1-(benzenesulfonyl)-4-phenyl-3-propylimidazolidin-2-one?
The InChIKey is GHBOODAQIZEYAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O3S/c1-2-13-19-17(15-9-5-3-6-10-15)14-20(18(19)21)24(22,23)16-11-7-4-8-12-16/h3-12,17H,2,13-14H2,1H3.
What are the key properties of 1-(benzenesulfonyl)-4-phenyl-3-propylimidazolidin-2-one?
1-(benzenesulfonyl)-4-phenyl-3-propylimidazolidin-2-one has a molecular weight of 344.44 g/mol, XLogP of 3.26, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(benzenesulfonyl)-4-phenyl-3-propylimidazolidin-2-one is sourced from PubChem (CID 15418827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).